{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6660422 0.1321237 2.521111 ] [ 1.154832 2.450071 0.6217319 ] [ 0.2052378 1.707228 1.69737 ] [ 2.767871 1.123615 2.427941 ] [ 1.781428 1.004966 1.555643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.660422e-11 1.321237e-11 2.521111e-10 ] [ 1.154832e-10 2.450071e-10 6.217319e-11 ] [ 2.052378e-11 1.707228e-10 1.69737e-10 ] [ 2.767871e-10 1.123615e-10 2.427941e-10 ] [ 1.781428e-10 1.004966e-10 1.555643e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.3149231 -47.6365582 37.7364981 ] [ 22.5162752 51.0692395 -54.0866269 ] [ -80.2629335 16.5986535 28.0104799 ] [ 106.6232516 12.6285634 93.6444203 ] [ -27.5616702 -32.6598982 -105.3047713 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.415027174632685e-08 -7.63221804722211e-08 6.046053550480539e-08 ] [ 3.607505001015367e-08 8.182194224304984e-08 -8.665632983105584e-08 ] [ -1.285953966299958e-07 2.659397479356232e-08 4.487773640290665e-08 ] [ 1.708292823546231e-07 2.02331892004676e-08 1.500349021091352e-07 ] [ -4.41586639884541e-08 -5.232692576485865e-08 -1.687168440255738e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 91.518335 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.466285379195844e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.3986508 -0.0944994 2.554827 ] [ 1.2223665 2.6132167 0.5051119 ] [ -0.6373082 2.0740109 2.0243088 ] [ 3.4280602 1.4316898 2.8095016 ] [ 2.1636417 0.3935857 0.9300476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.986508e-11 -9.44994e-12 2.554827e-10 ] [ 1.2223665e-10 2.6132167e-10 5.051119e-11 ] [ -6.373082e-11 2.0740109e-10 2.0243088e-10 ] [ 3.4280602e-10 1.4316898e-10 2.8095016e-10 ] [ 2.1636417e-10 3.935857e-11 9.300476e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.03e-05 9e-06 1e-05 ] [ 1.4e-06 -1.42e-05 -2.2e-06 ] [ 2.9e-06 -4e-06 7.8e-06 ] [ -1.68e-05 -1.04e-05 -6.5e-06 ] [ 2.29e-05 1.96e-05 -9.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.65024193302e-14 1.4419589706e-14 1.602176634e-14 ] [ 2.2430472876e-15 -2.27509082028e-14 -3.5247885948e-15 ] [ 4.6463122386e-15 -6.408706535999999e-15 1.24969777452e-14 ] [ -2.691656745119999e-14 -1.66626369936e-14 -1.0414148121e-14 ] [ 3.66898449186e-14 3.140266202639999e-14 -1.47400250328e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.027456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.92701089696631e-18 } }